N-[(3-chlorophenyl)methyl]-2-(propan-2-yl)-1,3-benzoxazole-6-carboxamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-2-(propan-2-yl)-1,3-benzoxazole-6-carboxamide
N-[(3-chlorophenyl)methyl]-2-(propan-2-yl)-1,3-benzoxazole-6-carboxamide
Compound characteristics
| Compound ID: | G706-1667 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-2-(propan-2-yl)-1,3-benzoxazole-6-carboxamide |
| Molecular Weight: | 328.8 |
| Molecular Formula: | C18 H17 Cl N2 O2 |
| Smiles: | CC(C)c1nc2ccc(cc2o1)C(NCc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.605 |
| logD: | 4.605 |
| logSw: | -4.6749 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.734 |
| InChI Key: | JZKQQWNIGYNETB-UHFFFAOYSA-N |